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3-Phenoxymethyl-2-phenacyl-1,4-naphthoquinone
SpectraBase Compound ID CRBTD4twAlD
InChI InChI=1S/C25H18O4/c26-23(17-9-3-1-4-10-17)15-21-22(16-29-18-11-5-2-6-12-18)25(28)20-14-8-7-13-19(20)24(21)27/h1-14H,15-16H2
InChIKey CUTBZFWUTIIHLQ-UHFFFAOYSA-N
Mol Weight 382.42 g/mol
Molecular Formula C25H18O4
Exact Mass 382.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1yDiByskLoF
Name 3-Phenoxymethyl-2-phenacyl-1,4-naphthoquinone
Alternate Name(s) 2-(2-oxo-2-phenylethyl)-3-(phenoxymethyl)naphthoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H18O4
InChI InChI=1S/C25H18O4/c26-23(17-9-3-1-4-10-17)15-21-22(16-29-18-11-5-2-6-12-18)25(28)20-14-8-7-13-19(20)24(21)27/h1-14H,15-16H2
InChIKey CUTBZFWUTIIHLQ-UHFFFAOYSA-N
Molecular Weight 382.415 g/mol
SMILES C1(=C(C(=O)c2c(C1=O)cccc2)COc1ccccc1)CC(=O)c1ccccc1
SPLASH splash10-05ow-7690000000-41e1571c0cec4111d78f
Source of Spectrum F-55-2098-19
Wiley ID 836817